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CAS No.: | 5028-20-6 |
---|---|
Name: | N2-METHYL-PYRIDINE-2,3-DIAMINE |
Article Data: | 28 |
Molecular Structure: | |
Formula: | C6H9N3 |
Molecular Weight: | 123.158 |
Synonyms: | 2,3-Pyridinediamine, N2-methyl-; |
Density: | 1.18 g/cm3 |
Melting Point: | 100-101 °C |
Boiling Point: | 303.553 °C at 760 mmHg |
Flash Point: | 137.384 °C |
PSA: | 50.94000 |
LogP: | 1.35970 |
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The N2-Methyl-2,3-pyridinediamine, with the CAS registry number 5028-20-6, is also known as 2,3-Pyridinediamine, N2-methyl-. This chemical's molecular formula is C6H9N3 and molecular weight is 123.16.
Physical properties of N2-Methyl-2,3-pyridinediamine are: (1)ACD/LogP: 0.67; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 31; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 50.94 Å2; (12)Index of Refraction: 1.652; (13)Molar Refractivity: 38.19 cm3; (14)Molar Volume: 104.394 cm3; (15)Polarizability: 15.14×10-24 cm3; (16)Surface Tension: 56.449 dyne/cm; (17)Density: 1.18 g/cm3; (18)Flash Point: 137.384 °C; (19)Enthalpy of Vaporization: 54.385 kJ/mol; (20)Boiling Point: 303.553 °C at 760 mmHg; (21)Vapour Pressure: 0.001 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: Nc1cccnc1NC
(2)InChI: InChI=1/C6H9N3/c1-8-6-5(7)3-2-4-9-6/h2-4H,7H2,1H3,(H,8,9)
(3)InChIKey: COANMWJRJDRXNS-UHFFFAOYAH